[3H]RY80

Ligand id: 4364

Name: [3H]RY80    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 0
Rotatable bonds 3
Topological polar surface area 64.43
Molecular weight 309.11
XLogP 2.2
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
ethyl 8-ethynyl-5-methyl-6-oxo-4H-imidazo[1,5-a][1,4]benzodiazepine-3-carboxylate
Database Links
ChEMBL Ligand CHEMBL286594
PubChem CID 5311418
Search Google for chemical match using the InChIKey WDTNKNNGHGOKBH-UHFFFAOYSA-N
Search Google for chemicals with the same backbone WDTNKNNGHGOKBH
Search UniChem for chemical match using the InChIKey WDTNKNNGHGOKBH-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone WDTNKNNGHGOKBH